Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 4/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 3/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | IKBKB | O14920 | 1/20 | 0.35 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL12441406 | 0.93 | MAOB (0.39) | MAOBKDM1AMCHR1CHRM1HTR2A | |
| SCHEMBL5230226 | 0.84 | MCHR1 (0.61) | MCHR1CHRM1HTR2A | |
| SCHEMBL5222974 | 0.78 | MCHR1 (0.59) | MCHR1CHRM1HTR2A | |
| SCHEMBL12440216 | 0.76 | KDM1A (0.43) | MAOBKDM1AMCHR1CHRM1HTR2A | |
| SCHEMBL12440742 | 0.74 | KDM1A (0.42) | MAOBKDM1AMCHR1CHRM1HTR2A | |
| SCHEMBL12440597 | 0.73 | CNR2 (0.49) | MCHR1CNR2KCNH2 | |
| SCHEMBL12441099 | 0.72 | MCHR1 (0.72) | MCHR1CHRM1HTR2AHRH3SIGMAR1 | |
| SCHEMBL12440033 | 0.70 | SIGMAR1 (0.72) | MCHR1CHRM1HTR2AHRH3SIGMAR1 | |
| SCHEMBL12440750 | 0.69 | HRH3 (0.43) | MCHR1CHRM1HTR2AHTR2CKCNH2 | |
| SCHEMBL13894788 | 0.68 | MCHR1 (0.43) | MCHR1CHRM1HTR2AHSD11B1CNR2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2357173-A1 | New alkyne compounds with MCH-antagonistic activity and medicaments containing them | Boehringer Ingelheim Pharma GmbH & Co. KG (DE) | 2011-08-17 | — | — | EP | disclosed |